UCSF

ZINC39886205

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 25 No

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Annotations

None

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.68 6.53 -9.05 2 4 0 65 364.348 3
Hi High (pH 8-9.5) 5.14 5.51 -99.86 0 4 -2 71 362.332 3
Mid Mid (pH 6-8) 5.14 4.73 -43.26 1 4 -1 69 363.34 3

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Analogs ( Draw Identity 99% 90% 80% 70% )